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2-[5'-Acetyl-3'-phenyl-3H-(1,3,4)-thiadiazol-2'-ylidene]-3-(3"-methylthiazolo[3,2-a]benzimidazol-2"-yl)-3-oxopropionitrile
SpectraBase Compound ID JolOuHLilfb
InChI InChI=1S/C23H15N5O2S2/c1-13-20(31-23-25-17-10-6-7-11-18(17)27(13)23)19(30)16(12-24)22-28(15-8-4-3-5-9-15)26-21(32-22)14(2)29/h3-11H,1-2H3/b22-16-
InChIKey QIFDYAIEIRRDDL-JWGURIENSA-N
Mol Weight 457.53 g/mol
Molecular Formula C23H15N5O2S2
Exact Mass 457.066717 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWfc26cn66P
Name 2-[5'-Acetyl-3'-phenyl-3H-(1,3,4)-thiadiazol-2'-ylidene]-3-(3"-methylthiazolo[3,2-a]benzimidazol-2"-yl)-3-oxopropionitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H15N5O2S2
InChI InChI=1S/C23H15N5O2S2/c1-13-20(31-23-25-17-10-6-7-11-18(17)27(13)23)19(30)16(12-24)22-28(15-8-4-3-5-9-15)26-21(32-22)14(2)29/h3-11H,1-2H3/b22-16-
InChIKey QIFDYAIEIRRDDL-JWGURIENSA-N
Molecular Weight 457.526 g/mol
SMILES C1(=NN(\C(S1)=C\(C(C1=C([n]2c3ccccc3nc2S1)C)=O)C#N)c1ccccc1)C(=O)C
SPLASH splash10-0a4i-3000900000-d12c0e9e3787f4898ef3
Source of Spectrum AH-138-1008-11
Synonyms (2Z)-2-(5-acetyl-3-phenyl-1,3,4-thiadiazol-2(3H)-ylidene)-3-(3-methyl[1,3]thiazolo[3,2-a]benzimidazol-2-yl)-3-oxopropanenitrile
Wiley ID 1612500